methyl 3-azanyl-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-(4-methylphenoxy)benzoate

Systemtic Name: methyl 3-azanyl-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-(4-methylphenoxy)benzoate Openeye Name: methyl 3-amino-5-[(E)-dimethylaminomethyleneamino]sulfonyl-4-(4-methylphenoxy)benzoate CAS Name: 3-amino-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-(4-methylphenoxy)benzoic acid methyl ester IUPAC Name: methyl 3-amino-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-(4-methylphenoxy)benzoate Traditional Name: 3-amino-5-[(E)-dimethylaminomethyleneamino]sulfonyl-4-(4-methylphenoxy)benzoic acid methyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N=CN(C)C)C(=O)OC)N

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)/N=C/N(C)C)C(=O)OC)N

InChI

InChI=1S/C18H21N3O5S/c1-12-5-7-14(8-6-12)26-17-15(19)9-13(18(22)25-4)10-16(17)27(23,24)20-11-21(2)3/h5-11H,19H2,1-4H3/b20-11+